(5-heptylpyrimidin-2-yl) hydrogen carbonate

Systemtic Name: (5-heptylpyrimidin-2-yl) hydrogen carbonate Openeye Name: (5-heptylpyrimidin-2-yl) hydrogen carbonate CAS Name: carbonic acid (5-heptyl-2-pyrimidinyl) ester IUPAC Name: (5-heptylpyrimidin-2-yl) hydrogen carbonate Traditional Name: carbonic acid (5-heptylpyrimidin-2-yl) ester Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)OC(=O)O

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)OC(=O)O

InChI

InChI=1S/C12H18N2O3/c1-2-3-4-5-6-7-10-8-13-11(14-9-10)17-12(15)16/h8-9H,2-7H2,1H3,(H,15,16)